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Experimental and theoretical NMR study of 1H19F inter-ring coupling constants in 2-fluoronaphthalene

✍ Scribed by L. Cassidei; O. Sciacovelli


Book ID
103905752
Publisher
Elsevier Science
Year
1985
Tongue
English
Weight
334 KB
Volume
41
Category
Article
ISSN
1386-1425

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✦ Synopsis


An analysis of the 'H and 19F NMR spectra of 2-fluoronaphthalene was performed. 'H-19F inter-ring coupling constants were found to be positive over an even number of intervening bonds between the coupled nuclei and negative over an odd number. Such a sign alternation was based on a positive value for the hypefine interaction constant of the fragment C-F. Theoretical computation based on the finite perturbation theory (FPT) in the MO INDO approximation gives 'H-"F inter-ring coupling constant values which are in satisfactory agreement with the experimental ones. 'H-'H coupling constants follow the expected trend.


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